4-[2-(4-propylcyclohexyl)spiro[3.3]heptan-6-yl]benzenecarbonitrile

Systemtic Name: 4-[2-(4-propylcyclohexyl)spiro[3.3]heptan-6-yl]benzenecarbonitrile Openeye Name: 4-[2-(4-propylcyclohexyl)spiro[3.3]heptan-6-yl]benzonitrile CAS Name: 4-[2-(4-propylcyclohexyl)-6-spiro[3.3]heptanyl]benzonitrile IUPAC Name: 4-[2-(4-propylcyclohexyl)spiro[3.3]heptan-6-yl]benzonitrile Traditional Name: 4-[2-(4-propylcyclohexyl)spiro[3.3]heptan-6-yl]benzonitrile Formula: C23H31N MolecularWeight: 321.49894

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)C2CC3(C2)CC(C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CCCC1CCC(CC1)C2CC3(C2)CC(C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H31N/c1-2-3-17-4-8-19(9-5-17)21-12-23(13-21)14-22(15-23)20-10-6-18(16-24)7-11-20/h6-7,10-11,17,19,21-22H,2-5,8-9,12-15H2,1H3